In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 16 | No |
Popular Name: (3S)-3-[methyl-[(2-methylthiazol-4-yl)methyl]amino]pentanethioamide (3S)-3-[methyl-[(2-methylthiazol…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.68 | 4.39 | -33.85 | 3 | 3 | 1 | 43 | 258.436 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.68 | 3.85 | -10.83 | 2 | 3 | 0 | 42 | 257.428 | 6 | ↓ |